N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-3-(2-methoxyethylsulfamoyl)benzamide

Systemtic Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-3-(2-methoxyethylsulfamoyl)benzamide Openeye Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-3-(2-methoxyethylsulfamoyl)benzamide CAS Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-3-(2-methoxyethylsulfamoyl)benzamide IUPAC Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-3-(2-methoxyethylsulfamoyl)benzamide Traditional Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-3-(2-methoxyethylsulfamoyl)benzamide Formula: C21H31N5O4S2 MolecularWeight: 481.63194

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Descriptors Computed from Structure

Canonical SMILES:

COCCNS(=O)(=O)C1=CC=CC(=C1)C(=O)NCCCC2=NN=C(N2C3CCCC3)SC

Isomeric SMILES

COCCNS(=O)(=O)C1=CC=CC(=C1)C(=O)NCCCC2=NN=C(N2C3CCCC3)SC

InChI

InChI=1S/C21H31N5O4S2/c1-30-14-13-23-32(28,29)18-10-5-7-16(15-18)20(27)22-12-6-11-19-24-25-21(31-2)26(19)17-8-3-4-9-17/h5,7,10,15,17,23H,3-4,6,8-9,11-14H2,1-2H3,(H,22,27)